0 B6R0.6 C#CCCCCI CS-0088557 [0,0,0,0,0,0|1,0,2]=3 1 B6R0.6 C#CCCCCN CS-0059697 [0,0,0,0,0,0|1,0,2]=3 2 B6R0.6 C#CCCCCN CS-0106594 [0,0,0,0,0,0|1,0,2]=3 3 B6R0.6 C#CCNCCBr CS-0069298 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.2 C#CCCCI CS-0088561 [1,0,0,0,0,0|1,0,2]=4 5 B5R0.2 C#CCCCN CS-0038434 [1,0,0,0,0,0|1,0,2]=4 6 B5R0.2 CCCCON CS-0106180 [1,0,0,0,0,0|2,0,0]=3 7 B5R0.2 NCCCNN CS-0037551 [1,0,0,0,0,0|3,0,0]=4 8 B7R0.1 C#CCCCCCN CS-0104826 [0,1,0,0,0,0|1,0,1]=3 9 B7R0.1 C#CCOCCOC CS-0038923 [0,1,0,0,0,0|2,0,1]=4 10 B7R0.3 C#CCC[C@H](N)CO CS-0089531 [0,1,0,0,0,0|0,1,2]=4 11 B7R0.3 C=CCCC(N)CO CS-0091350 [0,1,0,0,0,0|0,1,2]=4 12 B7R0.3 CC#CCC(N)CO CS-0091348 [0,1,0,0,0,0|0,1,2]=4 13 B7R0.3 CCCCC(N)CO CS-0091368 [0,1,0,0,0,0|0,1,0]=2 14 B7R0.3 CCCC[C@@H](N)CO CS-0089933 [0,1,0,0,0,0|0,1,0]=2 15 B7R0.3 CCCC[C@H](N)CO CS-0089877 [0,1,0,0,0,0|0,1,0]=2 16 B7R0.3 COCCC(N)CO CS-0106481 [0,1,0,0,0,0|1,1,0]=3 17 B7R0.3 CSCCC(N)CO CS-0091223 [0,1,0,0,0,0|1,1,0]=3 18 B7R0.3 CSCC[C@@H](N)CO CS-0088128 [0,1,0,0,0,0|1,1,0]=3 19 B7R0.4 CC(=O)NCCCO CS-0037159 [0,1,0,0,0,0|1,1,1]=4 20 B7R0.4 CN(C)CCCCCl CS-0059660 [0,1,0,0,0,0|2,0,0]=3 21 B7R0.4 CN(C)CCCON CS-0093659 [0,1,0,0,0,0|3,0,0]=4 22 B7R0.4 NCCCCC(N)=O CS-0112084 [0,1,0,0,0,0|1,1,1]=4 23 B7R0.7 CCCC(Br)CCC CS-0106173 [0,1,0,0,0,0|1,0,0]=2 24 B7R0.7 CCOC(=O)CCN CS-W019943 [0,1,0,0,0,0|2,0,1]=4 25 B7R0.7 COCC(Br)COC CS-0089990 [0,1,0,0,0,0|3,0,0]=4 26 B7R0.7 COCC(Cl)COC CS-0089991 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.7 O=C(CCBr)CCBr CS-W007197 [0,1,0,0,0,0|2,0,1]=4 28 B7R1.1 BrCC1=CCCC1 CS-0052832 [0,0,0,1,0,0|1,0,2]=4 29 B7R1.1 BrCC1CCCO1 CS-0052243 [0,0,0,1,0,0|1,1,0]=3 30 B7R1.1 C#CC1CCCN1 CS-0051909 [0,0,0,1,0,0|1,0,2]=4 31 B7R1.1 C#CC1CCNC1 CS-0056570 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.1 CC[C@@H]1CCNC1 CS-0053328 [0,0,0,1,0,0|2,0,0]=3 33 B7R1.1 CC[C@H]1CCNC1 CS-0053268 [0,0,0,1,0,0|2,0,0]=3 34 B7R1.1 CNC1CCNC1 CS-0099966 [0,0,0,1,0,0|3,0,0]=4 35 B7R1.1 CNC1CCOC1 CS-0046706 [0,0,0,1,0,0|3,0,0]=4 36 B7R1.1 CNC1CCOC1 CS-0048784 [0,0,0,1,0,0|3,0,0]=4 37 B7R1.1 CNC1CCSC1 CS-0046714 [0,0,0,1,0,0|3,0,0]=4 38 B7R1.1 CN[C@@H]1CCNC1 CS-0035658 [0,0,0,1,0,0|3,0,0]=4 39 B7R1.1 CN[C@H]1CCOC1 CS-0053255 [0,0,0,1,0,0|3,0,0]=4 40 B7R1.1 COC1CCNC1 CS-0039937 [0,0,0,1,0,0|3,0,0]=4 41 B7R1.1 ClCC1CCCN1 CS-0106573 [0,0,0,1,0,0|2,0,0]=3 42 B7R1.1 ClC[C@@H]1CCCN1 CS-0106569 [0,0,0,1,0,0|2,0,0]=3 43 B7R1.1 ClC[C@H]1CCCN1 CS-0104825 [0,0,0,1,0,0|2,0,0]=3 44 B7R1.1 FC[C@@H]1CCCN1 CS-0053450 [0,0,0,1,0,0|2,0,0]=3 45 B7R1.1 FC[C@@H]1CCNC1 CS-0085105 [0,0,0,1,0,0|2,0,0]=3 46 B7R1.1 FC[C@H]1CCCN1 CS-0053502 [0,0,0,1,0,0|2,0,0]=3 47 B7R1.1 N#CC1CCCN1 CS-0048722 [0,0,0,1,0,0|2,0,1]=4 48 B7R1.1 N#C[C@@H]1CCCN1 CS-0053430 [0,0,0,1,0,0|2,0,1]=4 49 B7R1.1 N#C[C@@H]1CCNC1 CS-0053310 [0,0,0,1,0,0|2,0,1]=4 50 B7R1.1 N#C[C@@H]1CCOC1 CS-0053250 [0,0,0,1,0,0|2,0,1]=4 51 B7R1.1 N#C[C@H]1CCCN1 CS-0102312 [0,0,0,1,0,0|2,0,1]=4 52 B7R1.1 NCC1CCOC1 CS-0048762 [0,0,0,1,0,0|2,0,0]=3 53 B7R1.1 NCC1OCCO1 CS-D0489 [0,0,0,1,0,0|2,1,0]=4 54 B7R1.1 NC[C@@H]1CCOC1 CS-0053252 [0,0,0,1,0,0|2,0,0]=3 55 B7R1.1 NNC1CCCC1 CS-D0525 [0,0,0,1,0,0|2,0,0]=3 56 B7R1.1 OCC1CCNC1 CS-0048724 [0,0,0,1,0,0|1,1,0]=3 57 B7R1.1 OCC1OCCO1 CS-W019186 [0,0,0,1,0,0|2,1,0]=4 58 B7R1.1 OC[C@@H]1CCOC1 CS-0053251 [0,0,0,1,0,0|1,1,0]=3 59 B7R1.1 OC[C@H]1CCOC1 CS-0053313 [0,0,0,1,0,0|1,1,0]=3 60 B7R1.3 CC1COCCN1 CS-0038078 [0,0,0,1,0,0|2,0,0]=3 61 B7R1.3 FC1CCNCC1 CS-0101735 [0,0,0,1,0,0|2,0,0]=3 62 B7R1.3 F[C@@H]1CCCNC1 CS-0053327 [0,0,0,1,0,0|2,0,0]=3 63 B7R1.3 NC1CCCNC1 CS-W005316 [0,0,0,1,0,0|2,0,0]=3 64 B7R1.3 NN1CCNCC1 CS-0098935 [0,0,0,1,0,0|3,0,0]=4 65 B7R1.3 OC1CCCCN1 CS-0112594 [0,0,0,1,0,0|1,1,0]=3 66 B7R1.3 O[C@@H]1CCCNC1 CS-0053770 [0,0,0,1,0,0|1,1,0]=3 67 B7R1.3 O[C@@H]1CCCOC1 CS-0053086 [0,0,0,1,0,0|1,1,0]=3 68 B7R1.3 SC1CCCNC1 CS-0048753 [0,0,0,1,0,0|1,0,0]=2 69 B7R1.3 [C@H]1(C)CNCCN1 CS-W011321 [0,0,0,1,0,0|2,0,0]=3 70 B7R1.4 C[C@@H]1CCNC1=O CS-0046449 [0,0,0,1,0,0|1,1,1]=4 71 B7R1.4 C[C@@H]1COC[C@H]1N CS-0047781 [0,0,0,1,0,0|2,0,0]=3 72 B7R1.4 C[C@H]1CCC[C@@H]1O CS-0036071 [0,0,0,1,0,0|0,1,0]=2 73 B7R1.4 C[C@H]1CCNC1=O CS-0046446 [0,0,0,1,0,0|1,1,1]=4 74 B7R1.4 C[C@H]1CNC[C@@H]1O CS-0035605 [0,0,0,1,0,0|1,1,0]=3 75 B7R1.4 C[C@H]1CNC[C@H]1O CS-0036375 [0,0,0,1,0,0|1,1,0]=3 76 B7R1.4 F[C@H]1CNC[C@@H]1F CS-0047807 [0,0,0,1,0,0|3,0,0]=4 77 B7R1.4 F[C@H]1CNC[C@H]1F CS-0012663 [0,0,0,1,0,0|3,0,0]=4 78 B7R1.4 NC1CCCC1F CS-0101183 [0,0,0,1,0,0|2,0,0]=3 79 B7R1.4 NC1COCC1O CS-0112323 [0,0,0,1,0,0|2,1,0]=4 80 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-0096405 [0,0,0,1,0,0|1,1,0]=3 81 B7R1.4 N[C@@H]1CCC[C@H]1F CS-0047825 [0,0,0,1,0,0|2,0,0]=3 82 B7R1.4 N[C@@H]1CCC[C@H]1N CS-0047743 [0,0,0,1,0,0|2,0,0]=3 83 B7R1.4 N[C@@H]1CCC[C@H]1O CS-0096407 [0,0,0,1,0,0|1,1,0]=3 84 B7R1.4 N[C@@H]1CNC[C@@H]1F CS-0096695 [0,0,0,1,0,0|3,0,0]=4 85 B7R1.4 N[C@@H]1COC[C@@H]1F CS-0046590 [0,0,0,1,0,0|3,0,0]=4 86 B7R1.4 N[C@@H]1COC[C@@H]1N CS-0049723 [0,0,0,1,0,0|3,0,0]=4 87 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0049679 [0,0,0,1,0,0|2,1,0]=4 88 B7R1.4 N[C@@H]1COC[C@H]1N CS-0046716 [0,0,0,1,0,0|3,0,0]=4 89 B7R1.4 N[C@@H]1COC[C@H]1N CS-0053226 [0,0,0,1,0,0|3,0,0]=4 90 B7R1.4 N[C@@H]1COC[C@H]1O CS-0037840 [0,0,0,1,0,0|2,1,0]=4 91 B7R1.4 N[C@@H]1COC[C@H]1O CS-0046712 [0,0,0,1,0,0|2,1,0]=4 92 B7R1.4 N[C@@H]1CSC[C@@H]1O CS-0046601 [0,0,0,1,0,0|2,1,0]=4 93 B7R1.4 N[C@@H]1CSC[C@H]1O CS-0046604 [0,0,0,1,0,0|2,1,0]=4 94 B7R1.4 N[C@H]1CCC[C@H]1N CS-0049664 [0,0,0,1,0,0|2,0,0]=3 95 B7R1.4 N[C@H]1COC[C@@H]1N CS-0058692 [0,0,0,1,0,0|3,0,0]=4 96 B7R1.4 N[C@H]1COC[C@@H]1O CS-0047593 [0,0,0,1,0,0|2,1,0]=4 97 B7R1.4 N[C@H]1COC[C@H]1F CS-0092759 [0,0,0,1,0,0|3,0,0]=4 98 B7R1.4 N[C@H]1COC[C@H]1O CS-0053228 [0,0,0,1,0,0|2,1,0]=4 99 B7R1.4 O[C@@H]1CCC[C@H]1F CS-0101190 [0,0,0,1,0,0|1,1,0]=3 100 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0047354 [0,0,0,1,0,0|2,1,0]=4 101 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0058738 [0,0,0,1,0,0|2,1,0]=4 102 B7R1.4 O[C@H]1CNC[C@@H]1F CS-0047134 [0,0,0,1,0,0|2,1,0]=4 103 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0047805 [0,0,0,1,0,0|2,1,0]=4 104 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0058679 [0,0,0,1,0,0|2,1,0]=4 105 B7R1.4 O[C@H]1COC[C@H]1O CS-0049648 [0,0,0,1,0,0|2,1,0]=4 106 B7R1.4 [C@@H]1(N)CCC[C@H]1O CS-0031413 [0,0,0,1,0,0|1,1,0]=3 107 B7R1.6 C=CCC1CNC1 CS-0051668 [0,0,0,1,0,0|2,0,1]=4 108 B7R1.6 CCNC1COC1 CS-0045508 [0,0,0,1,0,0|3,0,0]=4 109 B7R1.6 CNCC1COC1 CS-0048871 [0,0,0,1,0,0|3,0,0]=4 110 B7R1.6 COCC1CCN1 CS-0052226 [0,0,0,1,0,0|2,0,0]=3 111 B7R1.6 COCC1CNC1 CS-0051676 [0,0,0,1,0,0|3,0,0]=4 112 B7R1.6 COC[C@@H]1CCN1 CS-0052225 [0,0,0,1,0,0|2,0,0]=3 113 B7R1.6 COC[C@@H]1CCN1 CS-0053449 [0,0,0,1,0,0|2,0,0]=3 114 B7R1.6 COC[C@H]1CCN1 CS-0053501 [0,0,0,1,0,0|2,0,0]=3 115 B7R1.6 N#CCC1CNC1 CS-0052251 [0,0,0,1,0,0|2,0,1]=4 116 B7R1.6 NCCC1CCO1 CS-0052220 [0,0,0,1,0,0|1,1,0]=3 117 B7R1.6 NNCC1CCC1 CS-0049633 [0,0,0,1,0,0|2,0,0]=3 118 B7R1.6 OCCC1CCN1 CS-0104824 [0,0,0,1,0,0|1,1,0]=3 119 B7R1.6 OCCC1CCO1 CS-0052219 [0,0,0,1,0,0|1,1,0]=3 120 B7R1.6 OCCC1CNC1 CS-0052250 [0,0,0,1,0,0|1,1,0]=3 121 B7R1.6 OCCC1COC1 CS-0052216 [0,0,0,1,0,0|1,1,0]=3 122 B7R1.6 OCC[C@H]1CCO1 CS-0057152 [0,0,0,1,0,0|1,1,0]=3 123 B7R1.7 OCC#CC1CC1 CS-0051385 [0,0,0,1,0,0|0,1,2]=4 124 B7R1.8 CN1CC[C@H]1CN CS-0053064 [0,0,0,1,0,0|2,0,0]=3 125 B7R1.8 O=C1CCC1CO CS-0045469 [0,0,0,1,0,0|1,1,1]=4 126 B7R1.8 OCC1CCC1F CS-0045492 [0,0,0,1,0,0|1,1,0]=3 127 B7R1.9 C#CC1CC1CO CS-0067820 [0,0,0,1,0,0|0,1,2]=4 128 B7R1.9 OC[C@H]1C[C@H]1CO CS-0053077 [0,0,0,1,0,0|1,1,0]=3 129 B7R1.24 C1CNCCOC1 CS-B1101 [0,0,0,1,0,0|1,1,0]=3 130 B4R0.2 CCCON CS-0106185 [2,0,0,0,0,0|2,0,0]=4 131 B4R0.2 CNCCF CS-0103514 [2,0,0,0,0,0|2,0,0]=4 132 B4R0.2 CNCCN CS-0108722 [2,0,0,0,0,0|2,0,0]=4 133 B4R0.2 COCCBr CS-0015336 [2,0,0,0,0,0|2,0,0]=4 134 B4R0.2 NCCCF CS-0088913 [2,0,0,0,0,0|2,0,0]=4 135 B6R0.1 CCCC(N)CO CS-0089892 [1,1,0,0,0,0|0,1,0]=3 136 B6R0.1 CCC[C@@H](N)CO CS-0088083 [1,1,0,0,0,0|0,1,0]=3 137 B6R0.1 COCC(N)CO CS-0091346 [1,1,0,0,0,0|1,1,0]=4 138 B6R0.1 COCC(N)CO CS-0106469 [1,1,0,0,0,0|1,1,0]=4 139 B6R0.1 COCC(O)CN CS-0106474 [1,1,0,0,0,0|2,0,0]=4 140 B6R0.1 COC[C@@H](N)CO CS-0091344 [1,1,0,0,0,0|1,1,0]=4 141 B6R0.1 COC[C@H](N)CO CS-0091345 [1,1,0,0,0,0|1,1,0]=4 142 B6R0.1 NC(CO)CCO CS-0091333 [1,1,0,0,0,0|1,1,0]=4 143 B6R0.1 N[C@@H](CO)CCO CS-0091341 [1,1,0,0,0,0|1,1,0]=4 144 B6R0.1 N[C@H](CO)CCO CS-0091335 [1,1,0,0,0,0|1,1,0]=4 145 B6R0.4 CC(=O)CCCBr CS-0103669 [1,1,0,0,0,0|1,0,1]=4 146 B6R0.4 CC(F)CCCN CS-0104689 [1,1,0,0,0,0|1,0,0]=3 147 B6R0.4 CN(C)CCCCl CS-W004690 [1,1,0,0,0,0|2,0,0]=4 148 B6R0.4 NCCCC(F)F CS-0098955 [1,1,0,0,0,0|2,0,0]=4 149 B8R0.4 C#CCCCCCCN CS-0110134 [0,2,0,0,0,0|1,0,0]=3 150 B8R0.4 COCCOCCOC CS-0017205 [0,2,0,0,0,0|1,1,0]=4 151 B8R0.4 NCCCCCCCO CS-0088962 [0,2,0,0,0,0|0,1,0]=3 152 B8R0.11 COC(CCCN)OC CS-WAA0041 [0,2,0,0,0,0|2,0,0]=4 153 B8R0.21 CCCCCS(=O)(=O)[O-] CS-W017507 [0,2,0,0,0,0|1,1,0]=4 154 B8R0.28 CC(C)CCCC(=O)O CS-0096310 [0,2,0,0,0,0|0,1,1]=4 155 B6R1.2 CC1CCCN1 CS-0051829 [1,0,0,1,0,0|1,0,0]=3 156 B6R1.2 NC1CCSC1 CS-0046717 [1,0,0,1,0,0|2,0,0]=4 157 B6R1.2 N[C@H]1CCOC1 CS-0053253 [1,0,0,1,0,0|2,0,0]=4 158 B6R1.2 OC1CCNC1 CS-W002985 [1,0,0,1,0,0|1,1,0]=4 159 B6R1.3 ICCC1CC1 CS-0012702 [1,0,0,1,0,0|1,0,0]=3 160 B6R1.3 NNCC1CC1 CS-0053098 [1,0,0,1,0,0|2,0,0]=4 161 B6R1.4 CC1OCC1O CS-0051834 [1,0,0,1,0,0|1,1,0]=4 162 B6R1.4 N[C@@H]1CC[C@H]1O CS-0045479 [1,0,0,1,0,0|1,1,0]=4 163 B6R1.4 N[C@H]1CC[C@H]1O CS-0049745 [1,0,0,1,0,0|1,1,0]=4 164 B6R1.6 BrCC1CCO1 CS-0045505 [1,0,0,1,0,0|1,1,0]=4 165 B6R1.6 CSC1CNC1 CS-0051673 [1,0,0,1,0,0|2,0,0]=4 166 B6R1.6 ClCC1COC1 CS-0051702 [1,0,0,1,0,0|2,0,0]=4 167 B6R1.6 FCC1CNC1 CS-0085106 [1,0,0,1,0,0|2,0,0]=4 168 B6R1.6 FCC1CNC1 CS-0102314 [1,0,0,1,0,0|2,0,0]=4 169 B6R1.6 ICC1CCC1 CS-0053096 [1,0,0,1,0,0|1,0,0]=3 170 B6R1.6 ICC1CCO1 CS-0052227 [1,0,0,1,0,0|1,1,0]=4 171 B6R1.6 ICC1COC1 CS-0045504 [1,0,0,1,0,0|2,0,0]=4 172 B6R1.6 NCC1CCN1 CS-0049914 [1,0,0,1,0,0|2,0,0]=4 173 B6R1.6 NCC1CCO1 CS-0048767 [1,0,0,1,0,0|1,1,0]=4 174 B6R1.6 NCC1CNC1 CS-0089832 [1,0,0,1,0,0|2,0,0]=4 175 B6R1.6 NCC1COC1 CS-W008698 [1,0,0,1,0,0|2,0,0]=4 176 B6R1.6 NCC1CSC1 CS-0045533 [1,0,0,1,0,0|2,0,0]=4 177 B6R1.6 NC[C@@H]1CCO1 CS-0100100 [1,0,0,1,0,0|1,1,0]=4 178 B6R1.6 NC[C@H]1CCO1 CS-0102901 [1,0,0,1,0,0|1,1,0]=4 179 B6R1.6 OCC1CCN1 CS-0049913 [1,0,0,1,0,0|1,1,0]=4 180 B6R1.6 OCC1CSC1 CS-0045518 [1,0,0,1,0,0|1,1,0]=4 181 B6R1.8 COC1CC1N CS-0096341 [1,0,0,1,0,0|2,0,0]=4 182 B6R1.8 CO[C@@H]1C[C@H]1N CS-0081493 [1,0,0,1,0,0|2,0,0]=4 183 B8R1.2 BrCC1=CCCCC1 CS-0052833 [0,1,0,1,0,0|1,0,1]=4 184 B8R1.2 BrCC1CCCNC1 CS-0112575 [0,1,0,1,0,0|1,0,0]=3 185 B8R1.2 BrCC1CCCOC1 CS-D0475 [0,1,0,1,0,0|1,0,0]=3 186 B8R1.2 BrCC1COCCO1 CS-0099875 [0,1,0,1,0,0|1,1,0]=4 187 B8R1.2 C#CC1CCNCC1 CS-0050866 [0,1,0,1,0,0|1,0,1]=4 188 B8R1.2 C#CC1CCNCC1 CS-0081005 [0,1,0,1,0,0|1,0,1]=4 189 B8R1.2 C#CC1CCOCC1 CS-0050867 [0,1,0,1,0,0|1,0,1]=4 190 B8R1.2 C#CC1CCSCC1 CS-0050864 [0,1,0,1,0,0|1,0,1]=4 191 B8R1.2 CC[C@@H]1CNCCO1 CS-0096526 [0,1,0,1,0,0|0,1,0]=3 192 B8R1.2 CC[C@@H]1CNCCO1 CS-0100798 [0,1,0,1,0,0|0,1,0]=3 193 B8R1.2 CC[C@H]1CNCCO1 CS-0094360 [0,1,0,1,0,0|0,1,0]=3 194 B8R1.2 CC[C@H]1CNCCO1 CS-0100795 [0,1,0,1,0,0|0,1,0]=3 195 B8R1.2 CNC1CCNCC1 CS-0048783 [0,1,0,1,0,0|2,0,0]=4 196 B8R1.2 CNC1CCOCC1 CS-D1570 [0,1,0,1,0,0|2,0,0]=4 197 B8R1.2 COC1CCCNC1 CS-0051284 [0,1,0,1,0,0|1,1,0]=4 198 B8R1.2 CO[C@H]1CCCNC1 CS-0053262 [0,1,0,1,0,0|1,1,0]=4 199 B8R1.2 ClCC1CCNCC1 CS-0051167 [0,1,0,1,0,0|1,0,0]=3 200 B8R1.2 ClCC1CNCCO1 CS-0060823 [0,1,0,1,0,0|1,1,0]=4 201 B8R1.2 FCC1CCCNC1 CS-0105992 [0,1,0,1,0,0|1,0,0]=3 202 B8R1.2 FCC1CCNCC1 CS-0051153 [0,1,0,1,0,0|1,0,0]=3 203 B8R1.2 FCC1CNCCN1 CS-0106315 [0,1,0,1,0,0|2,0,0]=4 204 B8R1.2 N#CC1CCCCN1 CS-0048755 [0,1,0,1,0,0|1,0,1]=4 205 B8R1.2 N#CC1CCCNC1 CS-0048754 [0,1,0,1,0,0|1,0,1]=4 206 B8R1.2 N#CC1CCSCC1 CS-0045921 [0,1,0,1,0,0|1,0,1]=4 207 B8R1.2 N#C[C@@H]1CCCCN1 CS-0049775 [0,1,0,1,0,0|1,0,1]=4 208 B8R1.2 N#C[C@@H]1CCCNC1 CS-0060758 [0,1,0,1,0,0|1,0,1]=4 209 B8R1.2 N#C[C@H]1CCCNC1 CS-0053248 [0,1,0,1,0,0|1,0,1]=4 210 B8R1.2 NCC1CCCOC1 CS-0048770 [0,1,0,1,0,0|1,0,0]=3 211 B8R1.2 NCC1CCCOC1 CS-D0477 [0,1,0,1,0,0|1,0,0]=3 212 B8R1.2 NCC1CCOCC1 CS-0036420 [0,1,0,1,0,0|1,0,0]=3 213 B8R1.2 NCC1CCSCC1 CS-0045666 [0,1,0,1,0,0|1,0,0]=3 214 B8R1.2 NCC1CCSCC1 CS-0047857 [0,1,0,1,0,0|1,0,0]=3 215 B8R1.2 NCC1CNCCN1 CS-0112092 [0,1,0,1,0,0|2,0,0]=4 216 B8R1.2 NC[C@@H]1COCCO1 CS-0037059 [0,1,0,1,0,0|1,1,0]=4 217 B8R1.2 NNC1CCNCC1 CS-0109590 [0,1,0,1,0,0|2,0,0]=4 218 B8R1.2 O=CC1CCCOC1 CS-W008553 [0,1,0,1,0,0|0,1,1]=4 219 B8R1.2 O=CC1CCCSC1 CS-0100800 [0,1,0,1,0,0|0,1,1]=4 220 B8R1.2 O=CN1CCCCC1 CS-W016610 [0,1,0,1,0,0|0,1,1]=4 221 B8R1.2 OCC1CCCCO1 CS-0034490 [0,1,0,1,0,0|0,1,0]=3 222 B8R1.2 OCC1CCCOC1 CS-D0478 [0,1,0,1,0,0|0,1,0]=3 223 B8R1.2 OCC1CNCCN1 CS-0106316 [0,1,0,1,0,0|1,1,0]=4 224 B8R1.2 OCC1CNCCO1 CS-0106282 [0,1,0,1,0,0|1,1,0]=4 225 B8R1.2 OC[C@@H]1CNCCN1 CS-0112095 [0,1,0,1,0,0|1,1,0]=4 226 B8R1.2 OC[C@H]1CNCCN1 CS-0106317 [0,1,0,1,0,0|1,1,0]=4 227 B8R1.2 OC[C@H]1CNCCO1 CS-0108806 [0,1,0,1,0,0|1,1,0]=4 228 B8R1.5 CC1CCNCC1O CS-0050805 [0,1,0,1,0,0|0,1,0]=3 229 B8R1.5 CC1CNCCC1=O CS-D0300 [0,1,0,1,0,0|0,1,1]=4 230 B8R1.5 CC1CNCCC1O CS-0051241 [0,1,0,1,0,0|0,1,0]=3 231 B8R1.5 CC1COCCC1N CS-D0213 [0,1,0,1,0,0|1,0,0]=3 232 B8R1.5 C[C@@H]1CCNC[C@@H]1O CS-0038217 [0,1,0,1,0,0|0,1,0]=3 233 B8R1.5 C[C@@H]1CNCCN1C CS-0006864 [0,1,0,1,0,0|2,0,0]=4 234 B8R1.5 C[C@@H]1CNCCN1C CS-0053508 [0,1,0,1,0,0|2,0,0]=4 235 B8R1.5 C[C@@H]1CNCC[C@@H]1O CS-0100460 [0,1,0,1,0,0|0,1,0]=3 236 B8R1.5 C[C@@H]1CNCC[C@H]1O CS-0051211 [0,1,0,1,0,0|0,1,0]=3 237 B8R1.5 C[C@@H]1COCC[C@@H]1N CS-0098981 [0,1,0,1,0,0|1,0,0]=3 238 B8R1.5 C[C@@H]1COCC[C@H]1N CS-0053239 [0,1,0,1,0,0|1,0,0]=3 239 B8R1.5 C[C@H]1CCNC[C@@H]1O CS-0036436 [0,1,0,1,0,0|0,1,0]=3 240 B8R1.5 C[C@H]1CNCCN1C CS-0006863 [0,1,0,1,0,0|2,0,0]=4 241 B8R1.5 C[C@H]1CNCCN1C CS-0053455 [0,1,0,1,0,0|2,0,0]=4 242 B8R1.5 C[C@H]1COCC[C@@H]1N CS-0047776 [0,1,0,1,0,0|1,0,0]=3 243 B8R1.5 C[C@H]1COCC[C@@H]1N CS-0058689 [0,1,0,1,0,0|1,0,0]=3 244 B8R1.5 F[C@H]1CCNC[C@@H]1F CS-0054840 [0,1,0,1,0,0|2,0,0]=4 245 B8R1.5 F[C@H]1CCNC[C@H]1F CS-0049725 [0,1,0,1,0,0|2,0,0]=4 246 B8R1.5 NC1CCOCC1O CS-0104804 [0,1,0,1,0,0|1,1,0]=4 247 B8R1.5 N[C@@H]1CCCC[C@H]1F CS-0038959 [0,1,0,1,0,0|1,0,0]=3 248 B8R1.5 N[C@@H]1CCCC[C@H]1F CS-0058722 [0,1,0,1,0,0|1,0,0]=3 249 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0062471 [0,1,0,1,0,0|0,1,0]=3 250 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0096323 [0,1,0,1,0,0|0,1,0]=3 251 B8R1.5 N[C@@H]1CCNC[C@H]1O CS-0109627 [0,1,0,1,0,0|1,1,0]=4 252 B8R1.5 N[C@@H]1CCOC[C@@H]1F CS-0049705 [0,1,0,1,0,0|2,0,0]=4 253 B8R1.5 N[C@@H]1CCOC[C@@H]1F CS-0058693 [0,1,0,1,0,0|2,0,0]=4 254 B8R1.5 N[C@@H]1CCOC[C@@H]1F CS-0100794 [0,1,0,1,0,0|2,0,0]=4 255 B8R1.5 N[C@@H]1CCOC[C@@H]1O CS-0049677 [0,1,0,1,0,0|1,1,0]=4 256 B8R1.5 N[C@@H]1CCOC[C@H]1F CS-0053241 [0,1,0,1,0,0|2,0,0]=4 257 B8R1.5 N[C@@H]1CCOC[C@H]1F CS-0100799 [0,1,0,1,0,0|2,0,0]=4 258 B8R1.5 N[C@@H]1CCOC[C@H]1O CS-0053238 [0,1,0,1,0,0|1,1,0]=4 259 B8R1.5 N[C@@H]1COCC[C@@H]1O CS-0058644 [0,1,0,1,0,0|1,1,0]=4 260 B8R1.5 N[C@@H]1COCC[C@H]1O CS-0053305 [0,1,0,1,0,0|1,1,0]=4 261 B8R1.5 N[C@H]1CCCC[C@H]1O CS-W008152 [0,1,0,1,0,0|0,1,0]=3 262 B8R1.5 N[C@H]1CCNC[C@@H]1O CS-0109961 [0,1,0,1,0,0|1,1,0]=4 263 B8R1.5 N[C@H]1CCOC[C@@H]1F CS-0058691 [0,1,0,1,0,0|2,0,0]=4 264 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0029596 [0,1,0,1,0,0|1,1,0]=4 265 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0053298 [0,1,0,1,0,0|1,1,0]=4 266 B8R1.5 N[C@H]1CCOC[C@H]1F CS-0053232 [0,1,0,1,0,0|2,0,0]=4 267 B8R1.5 N[C@H]1CCOC[C@H]1F CS-0093952 [0,1,0,1,0,0|2,0,0]=4 268 B8R1.5 N[C@H]1CCOC[C@H]1O CS-0053229 [0,1,0,1,0,0|1,1,0]=4 269 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0047794 [0,1,0,1,0,0|1,1,0]=4 270 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0053233 [0,1,0,1,0,0|1,1,0]=4 271 B8R1.5 O=C1CCCCC1F CS-0040502 [0,1,0,1,0,0|0,1,1]=4 272 B8R1.5 OC1CCOCC1F CS-0051356 [0,1,0,1,0,0|1,1,0]=4 273 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101188 [0,1,0,1,0,0|0,1,0]=3 274 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101192 [0,1,0,1,0,0|0,1,0]=3 275 B8R1.5 O[C@@H]1CCNC[C@@H]1F CS-0102297 [0,1,0,1,0,0|1,1,0]=4 276 B8R1.5 O[C@@H]1CCNC[C@H]1F CS-0021964 [0,1,0,1,0,0|1,1,0]=4 277 B8R1.5 O[C@@H]1CCNC[C@H]1O CS-0047738 [0,1,0,1,0,0|1,1,0]=4 278 B8R1.5 O[C@@H]1CCOC[C@@H]1F CS-0049704 [0,1,0,1,0,0|1,1,0]=4 279 B8R1.5 O[C@@H]1CCOC[C@@H]1F CS-0058688 [0,1,0,1,0,0|1,1,0]=4 280 B8R1.5 O[C@@H]1CNCC[C@H]1F CS-0053301 [0,1,0,1,0,0|1,1,0]=4 281 B8R1.5 O[C@H]1CCCC[C@@H]1F CS-0101186 [0,1,0,1,0,0|0,1,0]=3 282 B8R1.5 O[C@H]1CCNC[C@@H]1F CS-0021965 [0,1,0,1,0,0|1,1,0]=4 283 B8R1.5 O[C@H]1CCNC[C@@H]1F CS-0035996 [0,1,0,1,0,0|1,1,0]=4 284 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0021967 [0,1,0,1,0,0|1,1,0]=4 285 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0039754 [0,1,0,1,0,0|1,1,0]=4 286 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0058642 [0,1,0,1,0,0|1,1,0]=4 287 B8R1.5 O[C@H]1CCOC[C@H]1F CS-0053299 [0,1,0,1,0,0|1,1,0]=4 288 B8R1.5 O[C@H]1CNCC[C@H]1O CS-0049724 [0,1,0,1,0,0|1,1,0]=4 289 B8R1.8 CCNC1CCOC1 CS-0048813 [0,1,0,1,0,0|1,1,0]=4 290 B8R1.8 CCO[C@H]1CCNC1 CS-0053269 [0,1,0,1,0,0|2,0,0]=4 291 B8R1.8 CNCC1CCOC1 CS-0048865 [0,1,0,1,0,0|1,1,0]=4 292 B8R1.8 COCC1CCNC1 CS-0038166 [0,1,0,1,0,0|1,1,0]=4 293 B8R1.8 COCC1CCNC1 CS-0058668 [0,1,0,1,0,0|1,1,0]=4 294 B8R1.8 COC[C@@H]1CCNC1 CS-0053335 [0,1,0,1,0,0|1,1,0]=4 295 B8R1.8 COC[C@H]1CCNC1 CS-0053272 [0,1,0,1,0,0|1,1,0]=4 296 B8R1.8 N#CCC1CCCC1 CS-0060786 [0,1,0,1,0,0|1,0,0]=3 297 B8R1.8 NCCC1CCCC1 CS-W006125 [0,1,0,1,0,0|1,0,0]=3 298 B8R1.8 OCCC1CCNC1 CS-0052204 [0,1,0,1,0,0|0,1,0]=3 299 B8R1.11 CN1CCC[C@@H]1CN CS-0053069 [0,1,0,1,0,0|1,0,0]=3 300 B8R1.11 CN1CCC[C@H]1CBr CS-0112933 [0,1,0,1,0,0|1,0,0]=3 301 B8R1.11 CO[C@@H]1CNC[C@@H]1F CS-0036147 [0,1,0,1,0,0|2,0,0]=4 302 B8R1.11 CO[C@@H]1CNC[C@@H]1O CS-0053237 [0,1,0,1,0,0|1,1,0]=4 303 B8R1.11 CO[C@@H]1CNC[C@H]1F CS-0106644 [0,1,0,1,0,0|2,0,0]=4 304 B8R1.11 CO[C@@H]1CNC[C@H]1O CS-0047754 [0,1,0,1,0,0|1,1,0]=4 305 B8R1.11 CO[C@@H]1COC[C@H]1N CS-0046713 [0,1,0,1,0,0|2,0,0]=4 306 B8R1.11 CO[C@H]1CNC[C@H]1O CS-0055739 [0,1,0,1,0,0|1,1,0]=4 307 B8R1.11 N[C@@H]1CNC[C@H]1CO CS-0094627 [0,1,0,1,0,0|1,1,0]=4 308 B8R1.11 OC[C@H]1OCC[C@@H]1O CS-0089202 [0,1,0,1,0,0|1,1,0]=4 309 B8R1.22 CC1CCCCNC1 CS-0038439 [0,1,0,1,0,0|1,0,0]=3 310 B8R1.22 CC1CNCCCN1 CS-0100317 [0,1,0,1,0,0|1,0,0]=3 311 B8R1.22 C[C@@H]1CNCCCN1 CS-0100401 [0,1,0,1,0,0|1,0,0]=3 312 B8R1.22 C[C@H]1CNCCCN1 CS-0100318 [0,1,0,1,0,0|1,0,0]=3 313 B8R1.22 NC1CCCCCC1 CS-0071927 [0,1,0,1,0,0|1,0,0]=3 314 B8R1.22 OC1CCCNCC1 CS-0038201 [0,1,0,1,0,0|0,1,0]=3 315 B8R1.22 SC1CCCCCC1 CS-0106062 [0,1,0,1,0,0|0,0,0]=2 316 B8R1.36 NCCNCC1CC1 CS-0053535 [0,1,0,1,0,0|1,0,0]=3 317 B8R1.1 CCC1CCC(=O)N1 CS-0046651 [0,1,0,1,0,0|0,1,1]=4 318 B8R1.1 CCN1CCC(N)C1 CS-0052564 [0,1,0,1,0,0|2,0,0]=4 319 B8R1.1 CCN1CCC(O)C1 CS-W016601 [0,1,0,1,0,0|1,1,0]=4 320 B8R1.1 CCN1CC[C@@H](N)C1 CS-0053343 [0,1,0,1,0,0|2,0,0]=4 321 B8R1.1 CCN1CC[C@H](N)C1 CS-0053283 [0,1,0,1,0,0|2,0,0]=4 322 B8R1.1 CN1CCC(CN)C1 CS-0053642 [0,1,0,1,0,0|2,0,0]=4 323 B8R1.1 CN1CC[C@@H](CN)C1 CS-0053042 [0,1,0,1,0,0|2,0,0]=4 324 B8R1.1 CN1CC[C@@H](CN)C1 CS-0053043 [0,1,0,1,0,0|2,0,0]=4 325 B8R1.1 CN1CC[C@@H](CO)C1 CS-D0333 [0,1,0,1,0,0|1,1,0]=4 326 B8R1.1 CN1CC[C@H](CN)C1 CS-0053048 [0,1,0,1,0,0|2,0,0]=4 327 B8R1.1 CN1CC[C@H](CO)C1 CS-0053041 [0,1,0,1,0,0|1,1,0]=4 328 B8R1.1 N#C[C@H]1CC[C@@H](O)C1 CS-0038000 [0,1,0,1,0,0|1,0,1]=4 329 B8R1.1 NCC1CCC(F)C1 CS-0047567 [0,1,0,1,0,0|1,0,0]=3 330 B8R1.1 NCC1CCC(O)C1 CS-0107088 [0,1,0,1,0,0|1,0,0]=3 331 B8R1.1 OCC1CCC(O)C1 CS-0108613 [0,1,0,1,0,0|0,1,0]=3 332 B8R1.1 OC[C@@H]1C[C@@H](F)CN1 CS-0035888 [0,1,0,1,0,0|1,1,0]=4 333 B8R1.1 OC[C@H]1C[C@@H](O)CO1 CS-0060089 [0,1,0,1,0,0|1,1,0]=4 334 B8R1.1 OC[C@H]1C[C@H](O)CN1 CS-0053224 [0,1,0,1,0,0|1,1,0]=4 335 B8R1.3 CC1CNC(C)CN1 CS-0106273 [0,1,0,1,0,0|2,0,0]=4 336 B8R1.3 C[C@H]1CC[C@@H](O)CN1 CS-0057814 [0,1,0,1,0,0|1,0,0]=3 337 B8R1.3 C[C@H]1CN[C@@H](C)CN1 CS-0048757 [0,1,0,1,0,0|2,0,0]=4 338 B8R1.3 NC1CCC(=O)CC1 CS-0106163 [0,1,0,1,0,0|0,1,1]=4 339 B8R1.3 NC1CCC(F)CC1 CS-0106938 [0,1,0,1,0,0|1,0,0]=3 340 B8R1.3 N[C@H]1CC[C@@H](O)CC1 CS-0049680 [0,1,0,1,0,0|0,1,0]=3 341 B8R1.3 O=C1CCC(F)CC1 CS-0091730 [0,1,0,1,0,0|0,1,1]=4 342 B8R1.3 O=C1CCC(O)CC1 CS-D0911 [0,1,0,1,0,0|0,1,1]=4 343 B8R1.3 OC1CCC(S)CC1 CS-0106060 [0,1,0,1,0,0|0,0,0]=2 344 B8R1.3 O[C@H]1CC[C@@H](O)CC1 CS-0049754 [0,1,0,1,0,0|0,1,0]=3 345 B8R1.38 CC(CO)C1CCO1 CS-0052218 [0,1,0,1,0,0|1,1,0]=4 346 B8R1.38 NC(CO)C1CCC1 CS-0091364 [0,1,0,1,0,0|0,1,0]=3 347 B8R1.38 N[C@@H](CO)C1CCC1 CS-0091362 [0,1,0,1,0,0|0,1,0]=3 348 B8R1.38 N[C@H](CO)C1CCC1 CS-0089880 [0,1,0,1,0,0|0,1,0]=3 349 B8R1.40 NC(CO)CC1CC1 CS-0091357 [0,1,0,1,0,0|0,1,0]=3 350 B8R1.40 N[C@@H](CO)CC1CC1 CS-0091358 [0,1,0,1,0,0|0,1,0]=3 351 B8R1.40 N[C@H](CO)CC1CC1 CS-0091361 [0,1,0,1,0,0|0,1,0]=3 352 B8R1.47 CCN1CC(CN)C1 CS-0045566 [0,1,0,1,0,0|2,0,0]=4 353 B8R1.47 CO[C@H]1C[C@@H](CN)C1 CS-0052977 [0,1,0,1,0,0|2,0,0]=4 354 B8R1.47 CO[C@H]1C[C@H](CN)C1 CS-0047778 [0,1,0,1,0,0|2,0,0]=4 355 B8R1.52 CC1(CN)CCCC1 CS-0037963 [0,1,0,1,0,0|1,0,0]=3 356 B8R1.52 CC1(CN)CCNC1 CS-0053353 [0,1,0,1,0,0|2,0,0]=4 357 B8R1.52 CC1(CN)CCOC1 CS-0053357 [0,1,0,1,0,0|2,0,0]=4 358 B8R1.52 C[C@@]1(CO)CCCN1 CS-0053062 [0,1,0,1,0,0|1,1,0]=4 359 B8R1.52 C[C@]1(CO)CCCN1 CS-0053068 [0,1,0,1,0,0|1,1,0]=4 360 B8R1.52 NC1(CO)CCCC1 CS-0088069 [0,1,0,1,0,0|0,1,0]=3 361 B8R1.52 NC1(CO)CCOC1 CS-0053386 [0,1,0,1,0,0|1,1,0]=4 362 B8R1.52 OC1(CF)CCNC1 CS-0051689 [0,1,0,1,0,0|2,0,0]=4 363 B8R1.52 OCC1(O)CCNC1 CS-0051680 [0,1,0,1,0,0|1,1,0]=4 364 B8R1.4 CC1CC(=O)CCN1 CS-0012636 [0,1,0,1,0,0|1,0,1]=4 365 B8R1.4 CC1CC(=O)CCN1 CS-0080309 [0,1,0,1,0,0|1,0,1]=4 366 B8R1.4 CC1CC(O)CCN1 CS-0051832 [0,1,0,1,0,0|1,0,0]=3 367 B8R1.4 CC1CC(O)CCN1 CS-0057464 [0,1,0,1,0,0|1,0,0]=3 368 B8R1.4 CC1CC(O)CCO1 CS-0051835 [0,1,0,1,0,0|0,1,0]=3 369 B8R1.4 CN1CCC[C@@H](N)C1 CS-0053341 [0,1,0,1,0,0|2,0,0]=4 370 B8R1.4 CN1CCC[C@@H](O)C1 CS-0053340 [0,1,0,1,0,0|1,1,0]=4 371 B8R1.4 CN1CCC[C@H](O)C1 CS-0053281 [0,1,0,1,0,0|1,1,0]=4 372 B8R1.4 C[C@@H]1CC(=O)CCN1 CS-0053488 [0,1,0,1,0,0|1,0,1]=4 373 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 CS-0053457 [0,1,0,1,0,0|2,0,0]=4 374 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-0088046 [0,1,0,1,0,0|1,1,0]=4 375 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-W005832 [0,1,0,1,0,0|1,1,0]=4 376 B8R1.4 C[C@@H]1COC[C@@H](C)N1 CS-0055639 [0,1,0,1,0,0|2,0,0]=4 377 B8R1.4 C[C@@H]1COC[C@@H](C)N1 CS-0112796 [0,1,0,1,0,0|2,0,0]=4 378 B8R1.4 C[C@@H]1C[C@H](O)CCN1 CS-0053467 [0,1,0,1,0,0|1,0,0]=3 379 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053434 [0,1,0,1,0,0|1,0,1]=4 380 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053435 [0,1,0,1,0,0|1,0,1]=4 381 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0053399 [0,1,0,1,0,0|2,0,0]=4 382 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0099931 [0,1,0,1,0,0|2,0,0]=4 383 B8R1.4 C[C@H]1CNC[C@H](C)O1 CS-0102294 [0,1,0,1,0,0|1,1,0]=4 384 B8R1.4 C[C@H]1COC[C@@H](C)N1 CS-0049722 [0,1,0,1,0,0|2,0,0]=4 385 B8R1.4 C[C@H]1COC[C@H](C)N1 CS-0102260 [0,1,0,1,0,0|2,0,0]=4 386 B8R1.4 C[C@H]1C[C@@H](O)CCN1 CS-0053413 [0,1,0,1,0,0|1,0,0]=3 387 B8R1.4 NC1CCCC(F)C1 CS-0106921 [0,1,0,1,0,0|1,0,0]=3 388 B8R1.4 NC1CCCC(F)C1 CS-0106922 [0,1,0,1,0,0|1,0,0]=3 389 B8R1.4 NC1COCC(O)C1 CS-0050678 [0,1,0,1,0,0|1,1,0]=4 390 B8R1.4 N[C@@H]1CCC[C@@H](F)C1 CS-0047783 [0,1,0,1,0,0|1,0,0]=3 391 B8R1.4 N[C@@H]1CCC[C@@H](N)C1 CS-0110011 [0,1,0,1,0,0|1,0,0]=3 392 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 CS-0047790 [0,1,0,1,0,0|0,1,0]=3 393 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-0112892 [0,1,0,1,0,0|0,1,0]=3 394 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-W007314 [0,1,0,1,0,0|0,1,0]=3 395 B8R1.4 N[C@H]1CCC[C@@H](N)C1 CS-0111626 [0,1,0,1,0,0|1,0,0]=3 396 B8R1.4 N[C@H]1CCC[C@H](N)C1 CS-0053558 [0,1,0,1,0,0|1,0,0]=3 397 B8R1.4 N[C@H]1CCC[C@H](O)C1 CS-0112699 [0,1,0,1,0,0|0,1,0]=3 398 B8R1.4 O=C1CCCC(O)C1 CS-0051335 [0,1,0,1,0,0|0,1,1]=4 399 B8R1.6 CCOC1CC(N)C1 CS-0102254 [0,1,0,1,0,0|2,0,0]=4 400 B8R1.6 CN1CC(CCO)C1 CS-0052322 [0,1,0,1,0,0|1,1,0]=4 401 B8R1.6 COCC1CC(N)C1 CS-0051675 [0,1,0,1,0,0|2,0,0]=4 402 B8R1.6 COC[C@H]1C[C@@H](N)C1 CS-0049727 [0,1,0,1,0,0|2,0,0]=4 403 B8R1.7 CC(C)[C@@H]1CCCN1 CS-0053448 [0,1,0,1,0,0|1,0,0]=3 404 B8R1.7 CC(C)[C@H]1CCCN1 CS-0053500 [0,1,0,1,0,0|1,0,0]=3 405 B8R1.7 CC(C)[C@H]1CCNC1 CS-0053334 [0,1,0,1,0,0|2,0,0]=4 406 B8R1.7 CC(N)C1CCCC1 CS-0052581 [0,1,0,1,0,0|1,0,0]=3 407 B8R1.7 CC(N)C1CCCO1 CS-0091427 [0,1,0,1,0,0|0,1,0]=3 408 B8R1.7 FC(F)C1CCNC1 CS-0051691 [0,1,0,1,0,0|2,0,0]=4 409 B8R1.7 FC(F)[C@@H]1CCCN1 CS-0053451 [0,1,0,1,0,0|2,0,0]=4 410 B8R1.7 FC(F)[C@@H]1CCNC1 CS-0085104 [0,1,0,1,0,0|2,0,0]=4 411 B8R1.7 N=C(N)C1CCCC1 CS-0038819 [0,1,0,1,0,0|1,0,1]=4 412 B8R1.19 CC1(C)CCN=C1S CS-0035637 [0,1,0,1,0,0|1,0,1]=4 413 B8R1.19 CC1CNCC1(F)F CS-0102311 [0,1,0,1,0,0|2,0,0]=4 414 B8R1.19 C[C@@]1(O)CCC[C@H]1N CS-0105761 [0,1,0,1,0,0|1,0,0]=3 415 B8R1.19 C[C@@]1(O)CCC[C@H]1N CS-0112219 [0,1,0,1,0,0|1,0,0]=3 416 B8R1.19 C[C@H]1COC[C@@]1(C)O CS-0047333 [0,1,0,1,0,0|1,1,0]=4 417 B8R1.19 NC1CCCC1(F)F CS-0108754 [0,1,0,1,0,0|2,0,0]=4 418 B8R1.27 OCCC1CC1(F)F CS-0054495 [0,1,0,1,0,0|1,1,0]=4 419 B8R1.34 CN(C)C[C@H]1CCN1 CS-0090866 [0,1,0,1,0,0|2,0,0]=4 420 B8R1.48 NCC1CCC1(F)F CS-0046530 [0,1,0,1,0,0|2,0,0]=4 421 B8R1.72 CC1(C)CNCCO1 CS-0052185 [0,1,0,1,0,0|1,1,0]=4 422 B8R1.72 CC1(C)COCCN1 CS-0061123 [0,1,0,1,0,0|2,0,0]=4 423 B8R1.72 CC1(N)CCNCC1 CS-0091552 [0,1,0,1,0,0|2,0,0]=4 424 B8R1.72 CC1(N)CCNCC1 CS-0091554 [0,1,0,1,0,0|2,0,0]=4 425 B8R1.72 CC1(N)CCOCC1 CS-0039635 [0,1,0,1,0,0|2,0,0]=4 426 B8R1.72 CC1(N)CCOCC1 CS-W018780 [0,1,0,1,0,0|2,0,0]=4 427 B8R1.72 CC1(O)CCCNC1 CS-0051242 [0,1,0,1,0,0|1,1,0]=4 428 B8R1.72 C[C@]1(O)CCCNC1 CS-0053261 [0,1,0,1,0,0|1,1,0]=4 429 B8R1.66 NC1(CCO)COC1 CS-0052287 [0,1,0,1,0,0|1,1,0]=4 430 B8R1.66 OCCC1(F)COC1 CS-0057751 [0,1,0,1,0,0|1,1,0]=4 431 B8R1.66 OCCC1(O)COC1 CS-0051770 [0,1,0,1,0,0|1,1,0]=4 432 B8R2.11 N[C@@H]1[C@H]2COC[C@H]21 CS-0035789 [0,0,0,2,0,0|2,0,0]=4 433 B8R2.22 C1CC2CNCC12 CS-0046699 [0,0,0,2,0,0|1,0,0]=3 434 B8R2.22 C1CC2CNCC12 CS-0046701 [0,0,0,2,0,0|1,0,0]=3 435 B8R2.22 C1NCC2NCC12 CS-0046539 [0,0,0,2,0,0|2,0,0]=4 436 B8R2.34 C1CC2CC1CN2 CS-0067833 [0,0,0,2,0,0|1,0,0]=3 437 B8R2.34 C1CC2CCC1N2 CS-0050113 [0,0,0,2,0,0|1,0,0]=3 438 B8R2.34 C1NC2CNC1C2 CS-0047653 [0,0,0,2,0,0|2,0,0]=4 439 B8R2.34 C1OC2CNC1C2 CS-0051828 [0,0,0,2,0,0|1,1,0]=4 440 B8R2.34 C1O[C@H]2CN[C@@H]1C2 CS-0053606 [0,0,0,2,0,0|1,1,0]=4 441 B8R2.34 [C@H]12CC[C@H](C1)NC2 CS-0067821 [0,0,0,2,0,0|1,0,0]=3 442 B8R2.55 C1CC2(CC2)CN1 CS-0058662 [0,0,0,2,0,0|2,0,0]=4 443 B8R2.55 C1CNC2(C1)CC2 CS-0088474 [0,0,0,2,0,0|1,0,0]=3 444 B8R2.55 C1CNC2(C1)CC2 CS-0103023 [0,0,0,2,0,0|1,0,0]=3 445 B8R2.2 CC12CCCC1O2 CS-0112282 [0,0,0,2,0,0|0,1,0]=3 446 B8R2.18 NC1CC2CC2C1 CS-0046677 [0,0,0,2,0,0|1,0,0]=3 447 B8R2.18 NC1CC2CC2C1 CS-0049781 [0,0,0,2,0,0|1,0,0]=3 448 B8R2.18 OC1CC2CC2C1 CS-0035529 [0,0,0,2,0,0|0,1,0]=3 449 B8R2.23 C1NCC2CC1C2 CS-0058463 [0,0,0,2,0,0|2,0,0]=4 450 B8R2.23 C1NCC2CC1O2 CS-0054897 [0,0,0,2,0,0|1,1,0]=4 451 B8R2.23 C1OCC2CC1N2 CS-0037985 [0,0,0,2,0,0|2,0,0]=4 452 B8R2.23 C1OCC2CC1N2 CS-0051232 [0,0,0,2,0,0|2,0,0]=4 453 B8R2.25 C1CC2CC2CN1 CS-0059003 [0,0,0,2,0,0|1,0,0]=3 454 B8R2.25 C1CC2NC2CO1 CS-0112795 [0,0,0,2,0,0|1,1,0]=4 455 B8R2.25 C1CC2OC2CO1 CS-0051589 [0,0,0,2,0,0|1,1,0]=4 456 B8R2.25 C1CNC2CC2N1 CS-0052146 [0,0,0,2,0,0|2,0,0]=4 457 B8R2.25 C1COC2CC2N1 CS-0112792 [0,0,0,2,0,0|1,1,0]=4 458 B8R2.38 [C@H]12C[C@H]1CC[C@@H]2O CS-0088889 [0,0,0,2,0,0|0,1,0]=3 459 B8R2.42 C1CC2(C1)CCN2 CS-0047658 [0,0,0,2,0,0|1,0,0]=3 460 B8R2.42 C1CC2(C1)CNC2 CS-0112364 [0,0,0,2,0,0|2,0,0]=4 461 B8R2.42 C1CC2(CNC2)O1 CS-0029784 [0,0,0,2,0,0|1,1,0]=4 462 B8R2.42 C1CC2(CNC2)S1 CS-0052354 [0,0,0,2,0,0|1,0,0]=3 463 B8R2.19 NC1CCC12CC2 CS-0067017 [0,0,0,2,0,0|1,0,0]=3 464 B8R2.19 O=C1CCC12CC2 CS-0048699 [0,0,0,2,0,0|0,1,1]=4 465 B8R2.20 N#CC1CC12CC2 CS-0067337 [0,0,0,2,0,0|1,0,1]=4 466 B8R2.20 NCC1CC12CC2 CS-0067342 [0,0,0,2,0,0|1,0,0]=3 467 B8R2.20 OCC1CC12CC2 CS-0067352 [0,0,0,2,0,0|0,1,0]=3 468 B8R2.24 C1CC1NC2CC2 CS-0108470 [0,0,0,2,0,0|2,0,0]=4 469 B8R2.24 C1CC1NC2CC2 CS-W019025 [0,0,0,2,0,0|2,0,0]=4